SCHEMBL6718429

SCHEMBL6718429

Cc1ccc(-c2ccncc2-c2ccc(CS(=O)(=O)Cc3ccc(-c4cnccc4-c4ccc(C)c(Cl)c4)cc3F)c(F)c2)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 6/20 0.44
PTGS1 P23219 3/20 0.44
RPS6KA3 P51812 11/20 0.43
DPP4 P27487 1/20 0.38
SCN9A Q15858 1/20 0.37
RPS6KA2 Q15349 1/20 0.36
RPS6KA1 Q15418 1/20 0.36
SLC22A12 Q96S37 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6718677 0.91 PTGS2 (0.44) PTGS2PTGS1RPS6KA3DPP4SCN9A
SCHEMBL6725948 0.91 RPS6KA3 (0.46) PTGS2RPS6KA3RPS6KA2RPS6KA1SLC22A12
SCHEMBL6722648 0.90 RPS6KA3 (0.45) PTGS2PTGS1RPS6KA3RPS6KA2RPS6KA1
SCHEMBL6722917 0.90 RPS6KA3 (0.45) PTGS2PTGS1RPS6KA3DPP4SCN9A
SCHEMBL6725964 0.87 RPS6KA3 (0.45) PTGS2PTGS1RPS6KA3RPS6KA2RPS6KA1
SCHEMBL6729769 0.87 RPS6KA3 (0.45) PTGS2RPS6KA3RPS6KA2RPS6KA1SLC22A12
SCHEMBL6730197 0.86 RPS6KA3 (0.43) PTGS2PTGS1RPS6KA3RPS6KA2RPS6KA1
SCHEMBL6723045 0.86 RPS6KA3 (0.45) PTGS2RPS6KA3DPP4RPS6KA2RPS6KA1
SCHEMBL6723317 0.86 RPS6KA3 (0.59) PTGS2PTGS1RPS6KA3RPS6KA2RPS6KA1
SCHEMBL6726046 0.86 PTGS2 (0.47) PTGS2PTGS1RPS6KA3DPP4SCN9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-05-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885PTGS1 4/4885RPS6KA3 972/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.